Basic information
- Standard SMILES
CC(=O)c1ccc(-c2ccco2)c(C)c1- InChIKey
GMIPRABXCJCWSX-UHFFFAOYSA-N- Molecular formula
- C13H12O2
- Average molar mass
- 200.23 g/mol
Names & identifiers
- Preferred name
- 1-[4-(2-Furyl)-3-methylphenyl]ethanone
- IUPAC
- 1-[4-(furan-2-yl)-3-methylphenyl]ethanone
Names & synonyms
SCHEMBL6513076GMIPRABXCJCWSX-UHFFFAOYSA-N1-[4-(2-Furyl)-3-methylphenyl]ethanone
Database identifiers
- PubChem CID
- 22316633
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 237
Related reactions
10 records
Compound notes
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